SCHEMBL31694567

SCHEMBL31694567

CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNc2nc(N)nc(-c3ccccc3)c2Br)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 8/20 0.44
▸ HPGDS O60760 2/20 0.42
▸ CKS1B P61024 2/20 0.41
▸ SKP1 P63208 2/20 0.41
▸ SKP2 Q13309 2/20 0.41
▸ ACKR3 P25106 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ EGFR P00533 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ KAT7 O95251 1/20 0.39
▸ KAT8 Q9H7Z6 1/20 0.39
▸ APLNR P35414 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28575909 1.00 USP30 (0.44) USP30HPGDSCKS1BSKP1SKP2
SCHEMBL28587989 0.88 KMT2A (0.38) USP30CKS1BSKP1SKP2MEN1
SCHEMBL23852704 0.85 P2RY12 (0.39) MEN1KMT2A
SCHEMBL24129923 0.81 USP30 (0.47) USP30HPGDSACKR3KAT7KAT8
SCHEMBL27157330 0.74 KMT2A (0.62) USP30HPGDSACKR3MEN1ALDH1A1
SCHEMBL23854039 0.72 ADORA2A (0.50) USP30HPGDSCKS1BSKP1SKP2
SCHEMBL3715390 0.72 ABL1 (0.62) USP30MEN1ALDH1A1MAPTKMT2A
SCHEMBL5870918 0.72 ABL1 (0.62) USP30MEN1ALDH1A1MAPTKMT2A
SCHEMBL21138345 0.71 KMT2A (0.46) USP30HPGDSMEN1ALDH1A1MAPT
SCHEMBL17533942 0.71 HDAC1 (0.62) USP30MEN1ALDH1A1MAPTKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382300-A1 SUBSTITUTED AMINO TRIAZOLOPYRIMIDINE AND AMINO TRIAZOLOPYRAZINE ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE MERCK SHARP & DOHME LLC (US) 2025-12-18 — — US disclosed
EP-3883575-B1 SUBSTITUTED AMINO TRIAZOLOPYRIMIDINE AND AMINO TRIAZOLOPYRAZINE ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE MERCK SHARP & DOHME LLC (US) 2025-10-08 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250382300-A1 SUBSTITUTED AMINO TRIAZOLOPYRIMIDINE AND AMINO TRIAZOLOPYRAZINE ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE ADORA2B, ADORA2A, ADORA3 USP30 4076/4885HPGDS 2527/4885CKS1B 955/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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